Monomers
2-Chloropropene
Identifiers
IUPAC name
2-chloroprop-1-ene
InchI
InChI=1S/C3H5Cl/c1-3(2)4/h1H2,2H3
InchI Key
PNLQPWWBHXMFCA-UHFFFAOYSA-N
SMILES
CC(=C)Cl
Canonical SMILES
CC(=C)Cl
Isomeric SMILES
CC(=C)Cl
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C3H5Cl
Heavy Atom Count
4
Molecular Weight
76.526
Exact Molecular Weight
76.008
Valence Electrons
24
Radical Electrons
0
tPSA
0.0
MolLogP
1.7588
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
9 8 0 0 0 0 0 0 0 0999 V2000
-1.0804 -0.3028 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1750 0.4717 -0.1357 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3135 -0.1160 0.1619 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1093 2.1382 -0.6714 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-0.9160 -1.2674 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9348 0.2658 -0.4338 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2319 -0.5054 1.0809 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3360 -1.1525 0.4934 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2292 0.4683 0.0655 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 3
2 4 1 0
1 5 1 0
1 6 1 0
1 7 1 0
3 8 1 0
3 9 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers